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DIPROPYL-2-[(BENZO-[D]-THIAZOL-2-YL-AMINO)-(BENZOFURAN-2-YL)-METHYL]-MALONATE

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DIPROPYL-2-[(BENZO-[D]-THIAZOL-2-YL-AMINO)-(BENZOFURAN-2-YL)-METHYL]-MALONATE
SpectraBase Compound ID FeSz2bEyPPJ
InChI InChI=1S/C25H26N2O5S/c1-3-13-30-23(28)21(24(29)31-14-4-2)22(19-15-16-9-5-7-11-18(16)32-19)27-25-26-17-10-6-8-12-20(17)33-25/h5-12,15,21-22H,3-4,13-14H2,1-2H3,(H,26,27)/t22-/m1/s1
InChIKey PGFXYIYAUMEHRH-JOCHJYFZSA-N
Mol Weight 466.55 g/mol
Molecular Formula C25H26N2O5S
Exact Mass 466.156243 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LDQcXbmb4UR
Name DIPROPYL-2-[(BENZO-[D]-THIAZOL-2-YL-AMINO)-(BENZOFURAN-2-YL)-METHYL]-MALONATE
Compound Number 5C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H26N2O5S
InChI InChI=1S/C25H26N2O5S/c1-3-13-30-23(28)21(24(29)31-14-4-2)22(19-15-16-9-5-7-11-18(16)32-19)27-25-26-17-10-6-8-12-20(17)33-25/h5-12,15,21-22H,3-4,13-14H2,1-2H3,(H,26,27)/t22-/m1/s1
InChIKey PGFXYIYAUMEHRH-JOCHJYFZSA-N
Literature Reference Author H.XIAO,P.ZHENG,C.TANG,Y.XIE,F.WU,J.SONG,J.ZHAO,Z.LI,M.LI
Literature Reference Citation MOLECULES,18,13623(2013)
Literature Reference DOI 10.3390/molecules181113623
Molecular Weight 466.552 g/mol
Solvent CDCl3
Source File Reference UWIR9859